| SpectraBase Compound ID | 54V3XqYQnOz |
|---|---|
| InChI | InChI=1S/C17H31NO3/c1-3-5-7-9-14-21-17(20)15-11-10-13-18(15)16(19)12-8-6-4-2/h15H,3-14H2,1-2H3 |
| InChIKey | VDSZTMZBBXBQAJ-UHFFFAOYSA-N |
| Mol Weight | 297.44 g/mol |
| Molecular Formula | C17H31NO3 |
| Exact Mass | 297.230394 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FqByOge0V7N |
|---|---|
| Name | L-Proline, N-(hexanoyl)-, hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 297.230393859 u |
| Formula | C17H31NO3 |
| InChI | InChI=1S/C17H31NO3/c1-3-5-7-9-14-21-17(20)15-11-10-13-18(15)16(19)12-8-6-4-2/h15H,3-14H2,1-2H3 |
| InChIKey | VDSZTMZBBXBQAJ-UHFFFAOYSA-N |
| SMILES | C1C(N(C(=O)CCCCC)CC1)C(=O)OCCCCCC |